compound 4a [Marquart et al., 1994]

Ligand id: 6707

Name: compound 4a [Marquart et al., 1994]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 23.47
Molecular weight 295.29
XLogP 6.22
No. Lipinski's rules broken 1

Molecular properties generated using the CDK